4-Piperidin-1-ylmethyl-phenol

HCID 11636972
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Basic information

CAS
73152-41-7
Standard SMILES
Oc1ccc(CN2CCCCC2)cc1
InChIKey
BPCKWVMOXOYTQI-UHFFFAOYSA-N
Molecular formula
C12H17NO
Average molar mass
191.27 g/mol
Monoisotopic mass
191.13101416

Names & identifiers

Preferred name
4-Piperidin-1-ylmethyl-phenol
IUPAC
4-(piperidin-1-ylmethyl)phenol
English name
4-(Piperidin-1-ylmethyl)phenol
Molecular formula
C12H17NO
Molecular weight
191.27

Names & synonyms

73152-41-74-Piperidin-1-ylmethyl-phenolDTXSID50469800RefChem:295573DTXCID504206184-(Piperidin-1-ylmethyl)phenolPhenol, 4-(1-piperidinylmethyl)-4-(1-Piperidinylmethyl)-phenolMFCD184534994-[(piperidin-1-yl)methyl]phenol4-((piperidin-1-yl)methyl)phenolp-(piperidinomethyl)phenol
Show more names
4-(1-Piperidinylmethyl)phenolSCHEMBL1888525SCHEMBL8804975BPCKWVMOXOYTQI-UHFFFAOYSA-NAKOS006280709SB42647BS-18017CS-0163021

Database identifiers

CAS
73152-41-7
PubChem CID
11636972
DTXSID
DTXSID50469800
Nikkaji
J1.746.325J

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
23.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14

Physicochemical properties

Melting point
140 °C · 140 °C
Boiling point
306.7 · 306.7±17.0 °C(Predicted)
Density
1.097 · 1.097±0.06 g/cm3(Predicted)
storage temp.
Inert atmosphere,Room Temperature
pka
9.88 · 9.88±0.10(Predicted)
Appearance
White to off-white Solid

Safety & regulation

Safety data

hs_code
2933399990

Chemistry & industry

Suppliers12 total

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]

Related reactions

9 records
New reaction record

Compound notes

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